[(2R)-3-chloranyl-2-oxidanyl-propyl]-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [(2R)-3-chloranyl-2-oxidanyl-propyl]-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [(2R)-3-chloro-2-hydroxy-propyl]-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [(2R)-3-chloro-2-hydroxypropyl]-[[1-[(2-fluorophenyl)methyl]-2-pyrrolyl]methyl]-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-3-chloro-2-hydroxypropyl]-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [(2R)-3-chloro-2-hydroxy-propyl]-[[1-(2-fluorobenzyl)pyrrol-2-yl]methyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H31ClFN3O2+2 MolecularWeight: 411.941143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[NH+](CC2=CC=CN2CC3=CC=CC=C3F)CC(CCl)O

Isomeric SMILES

C1COCC[NH+]1CC[NH+](CC2=CC=CN2CC3=CC=CC=C3F)C[C@H](CCl)O

InChI

InChI=1S/C21H29ClFN3O2/c22-14-20(27)17-25(9-8-24-10-12-28-13-11-24)16-19-5-3-7-26(19)15-18-4-1-2-6-21(18)23/h1-7,20,27H,8-17H2/p+2/t20-/m0/s1